ethyl 5-(3-acetamidopropanoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-(3-acetamidopropanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-(3-acetamidopropanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[(3-acetamido-1-oxopropyl)amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-acetamidopropanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(3-acetamidopropanoylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CCNC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CCNC(=O)C)C

InChI

InChI=1S/C13H18N2O4S/c1-4-19-13(18)12-8(2)7-11(20-12)15-10(17)5-6-14-9(3)16/h7H,4-6H2,1-3H3,(H,14,16)(H,15,17)